1,3-oxazole;quinoline;1,3-thiazole

C15H13N3OS — CID 158077050

IUPAC1,3-oxazole;quinoline;1,3-thiazole
SMILESc1ccc2ncccc2c1.c1cocn1.c1cscn1
InChIInChI=1S/C9H7N.C3H3NO.C3H3NS/c1-2-6-9-8(4-1)5-3-7-10-9;2*1-2-5-3-4-1/h1-7H;2*1-3H
InChIKeyFMMPNCQTNWHAKV-UHFFFAOYSA-N
MW283.36 g/mol
LogP4.05
Rot. Bonds

About 1,3-oxazole;quinoline;1,3-thiazole

1,3-oxazole;quinoline;1,3-thiazole (PubChem CID 158077050) has the molecular formula C15H13N3OS and a molecular weight of 283.36 g/mol. Its IUPAC name is 1,3-oxazole;quinoline;1,3-thiazole.

Molecular Properties

Compound Name1,3-oxazole;quinoline;1,3-thiazole
PubChem CID158077050
Molecular FormulaC15H13N3OS
Molecular Weight283.36 g/mol
Exact Mass283.08
IUPAC Name1,3-oxazole;quinoline;1,3-thiazole
SMILESc1ccc2ncccc2c1.c1cocn1.c1cscn1
InChIInChI=1S/C9H7N.C3H3NO.C3H3NS/c1-2-6-9-8(4-1)5-3-7-10-9;2*1-2-5-3-4-1/h1-7H;2*1-3H
InChIKeyFMMPNCQTNWHAKV-UHFFFAOYSA-N
XLogP4.05
TPSA51.81 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.36
LogP ≤ 54.05
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 1,3-oxazole;quinoline;1,3-thiazole?
The IUPAC name of 1,3-oxazole;quinoline;1,3-thiazole (CID 158077050) is 1,3-oxazole;quinoline;1,3-thiazole.
What is the SMILES notation for 1,3-oxazole;quinoline;1,3-thiazole?
The canonical SMILES for 1,3-oxazole;quinoline;1,3-thiazole is c1ccc2ncccc2c1.c1cocn1.c1cscn1.
What is the InChIKey of 1,3-oxazole;quinoline;1,3-thiazole?
The InChIKey is FMMPNCQTNWHAKV-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H7N.C3H3NO.C3H3NS/c1-2-6-9-8(4-1)5-3-7-10-9;2*1-2-5-3-4-1/h1-7H;2*1-3H.
What are the key properties of 1,3-oxazole;quinoline;1,3-thiazole?
1,3-oxazole;quinoline;1,3-thiazole has a molecular weight of 283.36 g/mol, XLogP of 4.05, 0 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1,3-oxazole;quinoline;1,3-thiazole is sourced from PubChem (CID 158077050), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).